SCHEMBL21064699

SCHEMBL21064699

C1CC([C@H]2CC[C@H]2C2CCC2)C1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20848037 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL29758993 0.96 ALDH1A1 (0.43) ALDH1A1
SCHEMBL6383024 0.92 ALDH1A1 (0.40) ALDH1A1
SCHEMBL3003480 0.89 ALDH1A1 (0.38) ALDH1A1
SCHEMBL11265164 0.87 ALDH1A1 (0.54) ALDH1A1
SCHEMBL6682956 0.87 ALDH1A1 (0.43) ALDH1A1
SCHEMBL16909193 0.87 ALDH1A1 (0.54) ALDH1A1
SCHEMBL375061 0.86 ALDH1A1 (0.44) ALDH1A1
SCHEMBL15454179 0.86 ALDH1A1 (0.44) ALDH1A1
SCHEMBL29885718 0.86 ALDH1A1 (0.44) ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10617687-B2 Fluorescent pyrazine derivatives and methods of using the same in assessing renal function MEDIBEACON INC. (US) 2020-04-14 US disclosed
US-RE47413-E1 Pyrazine derivatives and uses thereof in renal monitoring MEDIBEACON, INC. (US) 2019-06-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10617687-B2 Fluorescent pyrazine derivatives and methods of using the same in assessing renal function GLS, CYP4F12, XDH ALDH1A1 393/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.